B7JNE6 -OEChem-04022115593D 38 42 0 0 0 0 0 0 0999 V2000 3.0538 1.5498 -0.0760 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8032 -1.6625 1.3483 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7665 2.2511 0.5963 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8704 -2.0625 0.2872 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1502 -0.4215 -0.8858 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6903 3.4673 -0.5881 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 4.2448 -0.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2894 -0.9044 -0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4053 -2.3955 0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4177 -0.1101 -0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8195 -2.8496 -0.3834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0989 -0.1221 0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8154 -0.6416 -0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3702 1.2297 -0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2742 -0.6703 0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4496 2.3129 -0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3519 -1.7903 0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3471 -1.0572 -0.5892 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4893 -2.4887 1.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5234 -1.0238 -1.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2535 3.4946 0.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6403 -2.4392 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6593 -1.7169 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5914 3.8060 0.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6707 -2.8601 -0.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2014 -2.7405 1.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9419 -2.7737 -1.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9429 -3.9066 -0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2035 -0.5343 -1.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4703 -0.0716 0.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7857 -2.4403 0.0443 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4817 -3.0548 1.9638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5493 -0.4622 -2.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5316 -2.9729 0.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5637 -1.6897 -1.5427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8954 4.8158 0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6036 3.7476 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3299 3.1008 0.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 17 1 0 0 0 0 3 16 1 0 0 0 0 3 21 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 31 1 0 0 0 0 5 15 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 22 1 0 0 0 0 19 32 1 0 0 0 0 20 23 1 0 0 0 0 20 33 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$